SCHEMBL2360115

SCHEMBL2360115

Cc1cc(NC(=O)c2cc(C[C@H](C)O)n(-c3ccc(Cl)cc3OC(F)(F)F)c2C)ccc1S(C)(=O)=O

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 5/20 0.63
RORC P51449 4/20 0.45
AVPR2 P30518 2/20 0.40
GPR27 Q9NS67 2/20 0.40
PNLIP P16233 1/20 0.37
CNR2 P34972 1/20 0.37
KCNK3 O14649 2/20 0.36
KCNK9 Q9NPC2 2/20 0.36
IDH1 O75874 2/20 0.36
ALDH1A1 P00352 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2357191 0.93 NR3C2 (0.58) NR3C2RORCAVPR2GPR27PNLIP
SCHEMBL27997700 0.90 NR3C2 (0.78) NR3C2RORCAVPR2GPR27CNR2
SCHEMBL2359197 0.90 NR3C2 (0.78) NR3C2RORCAVPR2GPR27CNR2
SCHEMBL2547117 0.89 NR3C2 (0.58) NR3C2RORCAVPR2GPR27PNLIP
SCHEMBL2359248 0.88 NR3C2 (0.81) NR3C2RORCAVPR2GPR27ALDH1A1
SCHEMBL27997696 0.88 NR3C2 (0.81) NR3C2RORCAVPR2GPR27ALDH1A1
SCHEMBL2358996 0.82 NR3C2 (0.62) NR3C2AVPR2ALDH1A1
SCHEMBL2543882 0.82 NR3C2 (0.52) NR3C2PNLIPKCNK3KCNK9
SCHEMBL2358756 0.81 NR3C2 (0.66) NR3C2RORCALDH1A1
SCHEMBL2551383 0.81 NR3C2 (0.74) NR3C2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
US-8642640-B2 1-phenylpyrrole derivatives EXELIXIS, INC. (US) 2014-02-04 US disclosed
EP-2349996-B1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS INC (US) 2014-01-01 EP disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
US-20110263544-A1 1-Phenylpyrrole Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-10-27 US disclosed
EP-2349996-A1 1-PHENYLPYRROLE COMPOUNDS Exelixis, Inc. (US) 2011-08-03 EP disclosed
WO-2010042626-A1 1-PHENYLPYRROLE COMPOUNDS EXELIXIS, INC. (US) 2010-04-15 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110263544-A1 1-Phenylpyrrole Derivatives REN, AGTR1, NR3C2 NR3C2 3/4885RORC 2039/4885AVPR2 22/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.